2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-
TL;DR: 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- (CAS 53489-95-5) is a chemical compound with molecular formula C7H6F4N2O2 and molecular weight 226.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,3,3,3-tetrafluoropropyl)-1H-pyrimidine-2,4-dione
Also Known As: C(C(F)C(F)(F)F)c1cnc(O)nc1O, 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-, 5-(2,3,3,3-tetrafluoropropyl)-1H-pyrimidine-2,4-dione, 2,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-, 5-(2,3,3,3-Tetrafluoropropyl)-2,4(1H,3H)-pyrimidinedione
| Molecular Formula | C7H6F4N2O2 |
|---|---|
| Molecular Weight | 226.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.03654 |
| Heavy Atoms | 15 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 53489-95-5 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)N1)CC(C(F)(F)F)F |
| InChIKey | XIPBEGABMJCXNO-UHFFFAOYSA-N |
Product Overview
2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- (CAS 53489-95-5), with molecular formula C7H6F4N2O2 and molecular weight 226.04 g/mol. IUPAC: 5-(2,3,3,3-tetrafluoropropyl)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-
Property Insights of 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-. With a topological polar surface area (TPSA) of 58.2 Ų, 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-?
The CAS number of 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- is 53489-95-5.
What is the molecular formula of 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-?
The molecular formula of 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- is C7H6F4N2O2.
What is the molecular weight of 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-?
The molecular weight of 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- is 226.04 g/mol.
Where can I buy 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-?
You can request a quote for 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4(1H,3H)-Pyrimidinedione, 5-(2,3,3,3-tetrafluoropropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.